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N-(6-methyl-2-pyridinyl)-2-phenyl-2-(phenylsulfanyl)acetamide
SpectraBase Compound ID 7IkIpRGQg3S
InChI InChI=1S/C20H18N2OS/c1-15-9-8-14-18(21-15)22-20(23)19(16-10-4-2-5-11-16)24-17-12-6-3-7-13-17/h2-14,19H,1H3,(H,21,22,23)
InChIKey KENKAUKBMIGVKU-UHFFFAOYSA-N
Mol Weight 334.44 g/mol
Molecular Formula C20H18N2OS
Exact Mass 334.113984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3y52YR82ux
Name N-(6-Methyl-2-pyridinyl)-2-phenyl-2-(phenylsulfanyl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 334.113984381 u
Formula C20H18N2OS
InChI InChI=1S/C20H18N2OS/c1-15-9-8-14-18(21-15)22-20(23)19(16-10-4-2-5-11-16)24-17-12-6-3-7-13-17/h2-14,19H,1H3,(H,21,22,23)
InChIKey KENKAUKBMIGVKU-UHFFFAOYSA-N
Molecular Weight 334.437 g/mol
SMILES N(C(C(SC1=CC=CC=C1)C=1C=CC=CC1)=O)C1=NC(C)=CC=C1